BRD-K42260687-001-01-3
TL;DR: BRD-K42260687-001-01-3 (CAS 895804-48-5) is a chemical compound with molecular formula C21H20FN3O2S and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-N'-(2-methylphenyl)oxamide
Also Known As: BRD-K42260687-001-01-3, N-{2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-N'-(2-methylphenyl)ethanediamide, F2053-0364, N-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-N'-(2-methylphenyl)oxamide, N1-(2-(2-(3-fluorophenyl)-4-methylthiazol-5-yl)ethyl)-N2-(o-tolyl)oxalamide
| Molecular Formula | C21H20FN3O2S |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 3.86344 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.12604 |
| Heavy Atoms | 28 |
| Complexity | 1016.3902 |
Chemical Identifiers
| CAS Number | 895804-48-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C(=O)NCCC2=C(N=C(S2)C3=CC(=CC=C3)F)C |
Product Overview
BRD-K42260687-001-01-3 (CAS 895804-48-5), with molecular formula C21H20FN3O2S and molecular weight 397.13 g/mol. IUPAC: N-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]-N'-(2-methylphenyl)oxamide.
Chemical Property Profile of BRD-K42260687-001-01-3
Property Insights of BRD-K42260687-001-01-3
The XLogP value of 3.86344 indicates that BRD-K42260687-001-01-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K42260687-001-01-3. Following Lipinski's Rule of Five, BRD-K42260687-001-01-3 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRD-K42260687-001-01-3?
The CAS number of BRD-K42260687-001-01-3 is 895804-48-5.
What is the molecular formula of BRD-K42260687-001-01-3?
The molecular formula of BRD-K42260687-001-01-3 is C21H20FN3O2S.
What is the molecular weight of BRD-K42260687-001-01-3?
The molecular weight of BRD-K42260687-001-01-3 is 397.13 g/mol.
Where can I buy BRD-K42260687-001-01-3?
You can request a quote for BRD-K42260687-001-01-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K42260687-001-01-3?
Yes, KEHONG BIO provides custom synthesis services for BRD-K42260687-001-01-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.